8006-5990 Screening compound: N-[3-({2-[(E)-1-(5-bromo-2-hydroxyphenyl)methylidene]hydrazino}carbonyl)phenyl]pentanamide

8006-5990 Screening compound: N-[3-({2-[(E)-1-(5-bromo-2-hydroxyphenyl)methylidene]hydrazino}carbonyl)phenyl]pentanamide
8006-5990 Screening compound: N-[3-({2-[(E)-1-(5-bromo-2-hydroxyphenyl)methylidene]hydrazino}carbonyl)phenyl]pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-5990
N-[3-({2-[(E)-1-(5-bromo-2-hydroxyphenyl)methylidene]hydrazino}carbonyl)phenyl]pentanamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8006-5990

Molecular Formula

C19H20BrN3O3 (C19 H20 BrN3 O3)

Compound Name

N-[3-({2-[(E)-1-(5-bromo-2-hydroxyphenyl)methylidene]hydrazino}carbonyl)phenyl]pentanamide

IUPAC name

N-(3-{N'-[(E)-(5-bromo-2-hydroxyphenyl)methylidene]hydrazinecarbonyl}phenyl)pentanamide

SMILES

CCCCC(Nc1cccc(C(N/N=C/c(cc(cc2)Br)c2O)=O)c1)=O

InChI

InChI=1S/C19H20BrN3O3/c1-2-3-7-18(25)22-16-6-4-5-13(11-16)19(26)23-21-12-14-10-15(20)8-9-17(14)24/h4-6,8-12,24H,2-3,7H2,1H3,(H,22,25)(H,23,26)

InChI Key

QYUPMRDNVOVDKA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00774554

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.29

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.602

Distribution Coefficient, logD

4.506

Water Solubility, LogSw

-4.11

Polar Surface Area

75.252

Acid Dissociation Constant (pKa)

8.01

Base Dissociation Constant (pKb)

2.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.05

8006-5990 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8006-5990 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-5990?
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What is the minimum amount of 8006-5990 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-5990
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-5990
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8006-5990 available by request